SCHEMBL6517460

SCHEMBL6517460

C=C(CC(=O)OCCCCCC)C(=O)OCC(=O)CCCCCC

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.51
TSHR P16473 3/20 0.47
NAAA Q02083 1/20 0.47
DGKA P23743 1/20 0.47
HTR2C P28335 1/20 0.47
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
EPHX1 P07099 1/20 0.41
DNM1 Q05193 1/20 0.41
PAM P19021 2/20 0.41
EPHX2 P34913 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6515504 0.88 NAAA (0.53) FAAHTSHRNAAADGKAHTR2C
SCHEMBL6514782 0.87 TSHR (0.51) FAAHTSHRNAAADGKAHTR2C
SCHEMBL15156604 0.86 TSHR (0.62) FAAHTSHRNAAADGKAHTR2C
SCHEMBL9799832 0.86 TSHR (0.62) FAAHTSHRNAAADGKAHTR2C
SCHEMBL6658433 0.86 TSHR (0.62) FAAHTSHRNAAADGKAHTR2C
SCHEMBL3138822 0.86 TSHR (0.62) FAAHTSHRNAAADGKAHTR2C
SCHEMBL3625279 0.86 TSHR (0.62) FAAHTSHRNAAADGKAHTR2C
SCHEMBL892067 0.86 TSHR (0.62) FAAHTSHRNAAADGKAHTR2C
SCHEMBL1561906 0.86 TSHR (0.62) FAAHTSHRNAAADGKAHTR2C
SCHEMBL6657188 0.86 TSHR (0.62) FAAHTSHRNAAADGKAHTR2C

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed